N-[1-(4-methylphenyl)ethyl]-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[1-(4-methylphenyl)ethyl]-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: 4-(3-oxopiperazin-1-yl)sulfonyl-N-[1-(p-tolyl)ethyl]benzamide CAS Name: N-[1-(4-methylphenyl)ethyl]-4-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[1-(4-methylphenyl)ethyl]-4-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: 4-(3-ketopiperazino)sulfonyl-N-[1-(p-tolyl)ethyl]benzamide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCNC(=O)C3

Isomeric SMILES

CC1=CC=C(C=C1)C(C)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCNC(=O)C3

InChI

InChI=1S/C20H23N3O4S/c1-14-3-5-16(6-4-14)15(2)22-20(25)17-7-9-18(10-8-17)28(26,27)23-12-11-21-19(24)13-23/h3-10,15H,11-13H2,1-2H3,(H,21,24)(H,22,25)